Modeling of fixed-bed columns for gas physical adsorption

Adsorption processes may be classified as purification or bulk separation, depending on the feed concentration of the compounds to be adsorbed (adsorbates). The adsorption dynamics of a fixed-bed is crucial for a well-designed adsorption process. This work focuses on physical adsorption and provides...

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Autores: Gutiérrez Ortiz, Francisco Javier, Barragán Rodríguez, Manuel, Yang, Ralph T.
Tipo de recurso: artículo
Estado:Versión aceptada para publicación
Fecha de publicación:2019
País:España
Institución:Universidad de Sevilla (US)
Repositorio:idUS. Depósito de Investigación de la Universidad de Sevilla
OAI Identifier:oai:idus.us.es:11441/173647
Acceso en línea:https://hdl.handle.net/11441/173647
https://doi.org/10.1016/j.cej.2019.121985
Access Level:acceso abierto
Palabra clave:Breakthrough curve
Fixed-bed column
Adsorption
Gas separation
Modeling
Simulation
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spelling Modeling of fixed-bed columns for gas physical adsorptionGutiérrez Ortiz, Francisco JavierBarragán Rodríguez, ManuelYang, Ralph T.Breakthrough curveFixed-bed columnAdsorptionGas separationModelingSimulationAdsorption processes may be classified as purification or bulk separation, depending on the feed concentration of the compounds to be adsorbed (adsorbates). The adsorption dynamics of a fixed-bed is crucial for a well-designed adsorption process. This work focuses on physical adsorption and provides a modeling to predict the breakthrough curves using a minimum set of experimental data. The modeling does not require one to obtain key parameters from the experiment unlike other modeling found in the literature. In addition, boundary conditions, thermal effects, correlations to be used, and the homogeneous/heterogeneous modelings are discussed for 1-D modeling, after verifying that it provides the same output as 2-D modeling does. Moreover, it is demonstrated that pseudo-homogeneous modeling is realistic, so a more complex heterogeneous modeling is not necessary. The modeling has been tested against five sets of experimental data: three cases of bulk separation and two cases for purification. The simulation was carried out by Comsol Multiphysics software, and a good match between the experimental data and the simulation output was achieved, which demonstrates the applicability of the modeling, so it may be used with confidence. Purification can be modeled as an isothermal process, and no energy balance equation is needed. However, for bulk separation, noticeable thermal effects may take place due to the relatively high adsorbed gas that consequently releases a higher amount of heat; at the same time, the superficial fluid velocity is reduced due to the decrease in the flow-rate, and the gas properties change, affecting the breakthrough curves.ElsevierIngeniería Química y Ambiental2019info:eu-repo/semantics/articleinfo:eu-repo/semantics/acceptedVersionapplication/pdfapplication/pdfhttps://hdl.handle.net/11441/173647https://doi.org/10.1016/j.cej.2019.121985reponame:idUS. Depósito de Investigación de la Universidad de Sevillainstname:Universidad de Sevilla (US)InglésChemical Engineering Journal, 378, 121985.Supplementary Data, https://ars.els-cdn.com/content/image/1-s2.0-S1385894719313798-mmc1.docxhttps://www.sciencedirect.com/science/article/pii/S1385894719313798info:eu-repo/semantics/openAccessoai:idus.us.es:11441/1736472026-06-17T12:51:07Z
dc.title.none.fl_str_mv Modeling of fixed-bed columns for gas physical adsorption
title Modeling of fixed-bed columns for gas physical adsorption
spellingShingle Modeling of fixed-bed columns for gas physical adsorption
Gutiérrez Ortiz, Francisco Javier
Breakthrough curve
Fixed-bed column
Adsorption
Gas separation
Modeling
Simulation
title_short Modeling of fixed-bed columns for gas physical adsorption
title_full Modeling of fixed-bed columns for gas physical adsorption
title_fullStr Modeling of fixed-bed columns for gas physical adsorption
title_full_unstemmed Modeling of fixed-bed columns for gas physical adsorption
title_sort Modeling of fixed-bed columns for gas physical adsorption
dc.creator.none.fl_str_mv Gutiérrez Ortiz, Francisco Javier
Barragán Rodríguez, Manuel
Yang, Ralph T.
author Gutiérrez Ortiz, Francisco Javier
author_facet Gutiérrez Ortiz, Francisco Javier
Barragán Rodríguez, Manuel
Yang, Ralph T.
author_role author
author2 Barragán Rodríguez, Manuel
Yang, Ralph T.
author2_role author
author
dc.contributor.none.fl_str_mv Ingeniería Química y Ambiental
dc.subject.none.fl_str_mv Breakthrough curve
Fixed-bed column
Adsorption
Gas separation
Modeling
Simulation
topic Breakthrough curve
Fixed-bed column
Adsorption
Gas separation
Modeling
Simulation
description Adsorption processes may be classified as purification or bulk separation, depending on the feed concentration of the compounds to be adsorbed (adsorbates). The adsorption dynamics of a fixed-bed is crucial for a well-designed adsorption process. This work focuses on physical adsorption and provides a modeling to predict the breakthrough curves using a minimum set of experimental data. The modeling does not require one to obtain key parameters from the experiment unlike other modeling found in the literature. In addition, boundary conditions, thermal effects, correlations to be used, and the homogeneous/heterogeneous modelings are discussed for 1-D modeling, after verifying that it provides the same output as 2-D modeling does. Moreover, it is demonstrated that pseudo-homogeneous modeling is realistic, so a more complex heterogeneous modeling is not necessary. The modeling has been tested against five sets of experimental data: three cases of bulk separation and two cases for purification. The simulation was carried out by Comsol Multiphysics software, and a good match between the experimental data and the simulation output was achieved, which demonstrates the applicability of the modeling, so it may be used with confidence. Purification can be modeled as an isothermal process, and no energy balance equation is needed. However, for bulk separation, noticeable thermal effects may take place due to the relatively high adsorbed gas that consequently releases a higher amount of heat; at the same time, the superficial fluid velocity is reduced due to the decrease in the flow-rate, and the gas properties change, affecting the breakthrough curves.
publishDate 2019
dc.date.none.fl_str_mv 2019
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/acceptedVersion
format article
status_str acceptedVersion
dc.identifier.none.fl_str_mv https://hdl.handle.net/11441/173647
https://doi.org/10.1016/j.cej.2019.121985
url https://hdl.handle.net/11441/173647
https://doi.org/10.1016/j.cej.2019.121985
dc.language.none.fl_str_mv Inglés
language_invalid_str_mv Inglés
dc.relation.none.fl_str_mv Chemical Engineering Journal, 378, 121985.
Supplementary Data, https://ars.els-cdn.com/content/image/1-s2.0-S1385894719313798-mmc1.docx
https://www.sciencedirect.com/science/article/pii/S1385894719313798
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
application/pdf
dc.publisher.none.fl_str_mv Elsevier
publisher.none.fl_str_mv Elsevier
dc.source.none.fl_str_mv reponame:idUS. Depósito de Investigación de la Universidad de Sevilla
instname:Universidad de Sevilla (US)
instname_str Universidad de Sevilla (US)
reponame_str idUS. Depósito de Investigación de la Universidad de Sevilla
collection idUS. Depósito de Investigación de la Universidad de Sevilla
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